methyl 4-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzoate
methyl 4-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzoate
Compound characteristics
| Compound ID: | C999-1196 |
| Compound Name: | methyl 4-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzoate |
| Molecular Weight: | 373.41 |
| Molecular Formula: | C22 H19 N3 O3 |
| Smiles: | Cc1ccc(cc1)N1C(c2c(cccn2)C1=O)Nc1ccc(cc1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0951 |
| logD: | 4.0951 |
| logSw: | -4.2871 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.473 |
| InChI Key: | USHWFVXVQQELET-HXUWFJFHSA-N |